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89630-15-9 | 2-Quinoxalinecarboxamide, 3-[(aminocarbonyl)amino]-6,7-dimethyl-
CAS No: 89630-15-9 Catalog No: AG003X8C MDL No:
Product Description
Catalog Number:
AG003X8C
Chemical Name:
2-Quinoxalinecarboxamide, 3-[(aminocarbonyl)amino]-6,7-dimethyl-
CAS Number:
89630-15-9
Molecular Formula:
C12H13N5O2
Molecular Weight:
259.2639
IUPAC Name:
3-(carbamoylamino)-6,7-dimethylquinoxaline-2-carboxamide
InChI:
InChI=1S/C12H13N5O2/c1-5-3-7-8(4-6(5)2)16-11(17-12(14)19)9(15-7)10(13)18/h3-4H,1-2H3,(H2,13,18)(H3,14,16,17,19)
InChI Key:
IRYJZBUJTISIQE-UHFFFAOYSA-N
SMILES:
NC(=O)Nc1nc2cc(C)c(cc2nc1C(=O)N)C
Properties
Complexity:
375
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.107g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
259.269g/mol
Monoisotopic Mass:
259.107g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
124A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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